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2-[(7-{4-[2-(4-chlorophenoxy)ethyl]-1-piperazinyl}-4-nitro-2,1,3-benzoxadiazol-5-yl)(methyl)amino]ethanol
SpectraBase Compound ID GVOjYvAqrLe
InChI InChI=1S/C21H25ClN6O5/c1-25(10-12-29)18-14-17(19-20(24-33-23-19)21(18)28(30)31)27-8-6-26(7-9-27)11-13-32-16-4-2-15(22)3-5-16/h2-5,14,29H,6-13H2,1H3
InChIKey CBTDVLMGOBFVLH-UHFFFAOYSA-N
Mol Weight 476.92 g/mol
Molecular Formula C21H25ClN6O5
Exact Mass 476.157496 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2lBb0lyKr8h
Name 2-[(7-{4-[2-(4-chlorophenoxy)ethyl]-1-piperazinyl}-4-nitro-2,1,3-benzoxadiazol-5-yl)(methyl)amino]ethanol
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 476.157495624 u
Formula C21H25ClN6O5
InChI InChI=1S/C21H25ClN6O5/c1-25(10-12-29)18-14-17(19-20(24-33-23-19)21(18)28(30)31)27-8-6-26(7-9-27)11-13-32-16-4-2-15(22)3-5-16/h2-5,14,29H,6-13H2,1H3
InChIKey CBTDVLMGOBFVLH-UHFFFAOYSA-N
Molecular Weight 476.921 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1770
Solvent DMSO-d6
Source Vendor ID: NMR/12278370